Magnesium, bis[2-(hydroxy-κO)benzoato-κO]-, hydrate (1:4), (T-4)-

C₁₄H₁₈MgO₁₀CAS 18917-95-8370.59 g/mol

Open in Covalent MOL file

Carboxylic acid Phenol

Properties

Molecular formula: C₁₄H₁₈MgO₁₀
Molar mass: 370.59 g/mol
Exact mass: 370.0750 Da
logP: -3.47Crippen estimate
Polar surface area: 246.7 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 2

Identifiers

CAS number

18917-95-8

SMILES

O.O.O.O.O=C(O)c1ccccc1O.O=C([O-])c1ccccc1[O-].[Mg+2]

InChIKey

NBQBEWAYWAMLJJ-UHFFFAOYSA-L

InChI

InChI=1S/2C7H6O3.Mg.4H2O/c2*8-6-4-2-1-3-5(6)7(9)10;;;;;/h2*1-4,8H,(H,9,10);;4*1H2/q;;+2;;;;/p-2

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Names and synonyms

3 names

Magnesium, bis(salicylato)-, tetrahydrate
Magnesium, bis(2-hydroxybenzoato-O1,O2)-, tetrahydrate, (T-4)-
Magnesium, bis[2-(hydroxy-κO)benzoato-κO]-, tetrahydrate, (T-4)-

Work with Magnesium, bis[2-(hydroxy-κO)benzoato-κO]-, hydrate (1:4), (T-4)-

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(T-4)-Bis[2-(hydroxy-κO)benzoato-κO]magnesium18917-89-093 % similar Zinc salicylate16283-36-679 % similar Salicylic acid69-72-755 % similar Magnesium bis(monoperoxyphthalate) hexahydrate84665-66-753 % similar Ammonium salicylate528-94-951 % similar Potassium phthalate29801-94-350 % similar Sodium salicylate54-21-750 % similar Lithium salicylate552-38-550 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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